# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'C7O' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy C0 C -1.91300 1.10700 2.33000 1.000 C1 C -2.45000 1.09200 0.89700 1.000 C2 C -4.47900 2.46100 0.67900 1.000 C3 C -4.51400 -0.10100 1.61400 1.000 C4 C -3.28400 -0.17000 0.69600 1.000 C5 C -2.45400 -1.39900 1.06300 1.000 C6 C -3.35400 -2.63400 1.13400 1.000 N7 N -3.20900 2.30200 0.66900 1.000 N8 N -4.97300 3.72600 0.46300 1.000 O9 O -2.97200 -3.18800 -1.42000 1.000 C10 C -4.80100 -1.35400 -0.90600 1.000 O11 O -5.07400 -3.93100 -0.39700 1.000 N12 N 2.27900 0.15200 -0.06800 1.000 C13 C -3.74600 -0.25600 -0.75700 1.000 C14 C -1.28400 1.06100 -0.05800 1.000 C15 C -0.04800 0.62300 0.37500 1.000 C16 C 1.02600 0.59500 -0.50500 1.000 C17 C 3.40200 0.69200 -0.58100 1.000 C18 C 4.72300 0.14500 -0.20700 1.000 C19 C 5.98100 -1.36800 0.97000 1.000 F20 F -2.66500 1.89200 -1.79400 1.000 C21 C -1.45400 1.46800 -1.37100 1.000 S22 S -4.04400 -2.95800 -0.51500 1.000 S23 S -5.63000 1.15900 0.95100 1.000 C24 C -0.38500 1.44200 -2.25000 1.000 C25 C 0.85400 1.00900 -1.81900 1.000 O26 O 3.32800 1.63000 -1.35200 1.000 C27 C 5.88500 0.70400 -0.73700 1.000 N28 N 7.06500 0.21400 -0.40200 1.000 C29 C 7.14500 -0.80800 0.43800 1.000 N30 N 4.80500 -0.87800 0.64200 1.000 O31 O 8.35500 -1.31400 0.77700 1.000 C32 C 9.50300 -0.69200 0.19600 1.000 F33 F 9.73700 0.53600 0.82400 1.000 H34 H -1.30600 1.99900 2.48100 1.000 H35 H -2.74900 1.11400 3.03000 1.000 H36 H -1.30400 0.21900 2.49900 1.000 H37 H -5.01600 -1.06800 1.62800 1.000 H38 H -4.20800 0.17200 2.62400 1.000 H39 H -1.68400 -1.55400 0.30800 1.000 H40 H -1.98200 -1.24000 2.03300 1.000 H41 H -2.76800 -3.49400 1.46000 1.000 H42 H -4.16400 -2.45600 1.84100 1.000 H43 H -4.36400 4.46500 0.30900 1.000 H44 H -5.93100 3.87900 0.46400 1.000 H45 H -5.62600 -1.16300 -0.21900 1.000 H46 H -5.17400 -1.36500 -1.93000 1.000 H47 H 2.33900 -0.54500 0.60400 1.000 H48 H -4.17400 0.70100 -1.05700 1.000 H49 H -2.89300 -0.48400 -1.39500 1.000 H50 H 0.08300 0.30200 1.39800 1.000 H51 H 6.04700 -2.20100 1.65400 1.000 H52 H -0.52000 1.75900 -3.27300 1.000 H53 H 1.68800 0.98900 -2.50500 1.000 H54 H 5.82100 1.53600 -1.42200 1.000 H55 H 10.37100 -1.33800 0.32700 1.000 H56 H 9.32900 -0.52900 -0.86800 1.000